Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL22160044 | 0.79 | MAPK1 (0.43) | MAPK1KCNN4TAAR1ALDH1A1ALOX15 | |
| SCHEMBL30477708 | 0.79 | CYP19A1 (0.37) | MAPK1ALDH1A1ALOX15CYP3A4 | |
| SCHEMBL29105011 | 0.74 | TAAR1 (0.37) | MAPK1KCNN4TAAR1ALDH1A1ALOX15 | |
| SCHEMBL21110640 | 0.73 | MAPK1 (0.38) | MAPK1KCNN4TAAR1ALDH1A1ALOX15 | |
| SCHEMBL22188636 | 0.72 | ALDH1A1 (0.38) | MAPK1KCNN4TAAR1ALDH1A1ALOX15 | |
| SCHEMBL8996052 | 0.72 | MAPK1 (0.36) | MAPK1TAAR1ALDH1A1ALOX15CYP2D6 | |
| SCHEMBL31306987 | 0.72 | ALDH1A1 (0.38) | MAPK1ALDH1A1ALOX15MAPTKMT2A | |
| SCHEMBL3478682 | 0.72 | MAPK1 (0.48) | MAPK1KCNN4TAAR1ALDH1A1ALOX15 | |
| SCHEMBL2700899 | 0.72 | MAPK1 (0.48) | MAPK1KCNN4TAAR1ALDH1A1ALOX15 | |
| SCHEMBL30800830 | 0.71 | SMN1; SMN2 (0.34) | ALDH1A1ALOX15SMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5412119-A | Method of preparing vicinal aminoalcohols | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1995-05-02 | — | — | US | disclosed |
| EP-0554933-A1 | Method of preparing vicinal aminoalcohols | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1993-08-11 | — | — | EP | disclosed |